SpectraBase Spectrum ID |
EPElsjHtSsC |
Name |
Phenol, 2-sec-butyl-4,6-dinitro-, compd. with triethylamine (1:1) |
Alternate Name(s) |
2-sec-butyl-4,6-dinitrophenol, triethylamine salt
N,N-diethylethanaminium 2-sec-butyl-4,6-dinitrobenzenolate |
CAS Registry Number |
31931-88-1 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H27N3O5 |
InChI |
InChI=1S/C10H12N2O5.C6H15N/c1-3-6(2)8-4-7(11(14)15)5-9(10(8)13)12(16)17;1-4-7(5-2)6-3/h4-6,13H,3H2,1-2H3;4-6H2,1-3H3 |
InChIKey |
WXLFZVLKTRXDOP-UHFFFAOYSA-N |
Molecular Weight |
341.408 g/mol |
SMILES |
[NH+](CC)(CC)CC.c1(N(=O)=O)c(c(C(CC)C)cc(N(=O)=O)c1)[O-] |
SPLASH |
splash10-016r-9200000000-495f6a4fbf5609b3d8c8 |
Source of Spectrum |
W5-30325-0-0 |
Wiley ID |
1335808 |